3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one

C7H10N2O2 — CID 84763473

IUPAC3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one
SMILESCc1cnoc1C(=O)CCN
InChIInChI=1S/C7H10N2O2/c1-5-4-9-11-7(5)6(10)2-3-8/h4H,2-3,8H2,1H3
InChIKeyKFZXSMIEJQMBEW-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.51
Rot. Bonds3

About 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one

3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one (PubChem CID 84763473) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one.

Molecular Properties

Compound Name3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one
PubChem CID84763473
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one
SMILESCc1cnoc1C(=O)CCN
InChIInChI=1S/C7H10N2O2/c1-5-4-9-11-7(5)6(10)2-3-8/h4H,2-3,8H2,1H3
InChIKeyKFZXSMIEJQMBEW-UHFFFAOYSA-N
XLogP0.51
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-aminopropyl)-4-methyl-1,2-oxazole-5-carboxamide
CID 66335116
3-amino-1-(3,4-dimethyl-1,2-oxazol-5-yl)propan-1-one
CID 84765402
3-[(4-methyl-1,2-oxazole-5-carbonyl)amino]propanoic acid
CID 66334474
4-[(4-methyl-1,2-oxazole-5-carbonyl)amino]butanoic acid
CID 66334475
(2R)-5-amino-2-[(4-methyl-1,2-oxazole-5-carbonyl)amino]-5-oxopentanoic acid
CID 107830037
N-(2-ethylbutyl)-4-methyl-1,2-oxazole-5-carboxamide
CID 115668320
methyl 2-[(4-methyl-1,2-oxazole-5-carbonyl)amino]acetate
CID 66336334
N-methoxy-N,4-dimethyl-1,2-oxazole-5-carboxamide
CID 66335744
3-amino-1-(2-bromo-4,6-dimethylphenyl)propan-1-one
CID 84805177
3-amino-1-(2,4,5-trimethylphenyl)propan-1-one
CID 82281454
[4-(3-aminopropoxy)piperidin-1-yl]-(4-methyl-1,2-oxazol-5-yl)methanone
CID 79737157
N-(4-aminophenyl)-4-methyl-1,2-oxazole-5-carboxamide
CID 66335876

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one?
The IUPAC name of 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one (CID 84763473) is 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one.
What is the SMILES notation for 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one?
The canonical SMILES for 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one is Cc1cnoc1C(=O)CCN.
What is the InChIKey of 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one?
The InChIKey is KFZXSMIEJQMBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-5-4-9-11-7(5)6(10)2-3-8/h4H,2-3,8H2,1H3.
What are the key properties of 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one?
3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one has a molecular weight of 154.17 g/mol, XLogP of 0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(4-methyl-1,2-oxazol-5-yl)propan-1-one is sourced from PubChem (CID 84763473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).